{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,10,1]],"date-time":"2026-10-01T07:19:35Z","timestamp":1790839175973,"version":"4.1.0"},"reference-count":38,"publisher":"Informa UK Limited","issue":"7","content-domain":{"domain":["www.tandfonline.com"],"crossmark-restriction":true},"short-container-title":["Journal of Biomolecular Structure and Dynamics"],"published-print":{"date-parts":[[2020,5,2]]},"DOI":"10.1080\/07391102.2019.1627248","type":"journal-article","created":{"date-parts":[[2019,6,11]],"date-time":"2019-06-11T11:59:13Z","timestamp":1560254353000},"page":"2093-2103","update-policy":"https:\/\/doi.org\/10.1080\/tandf_crossmark_01","source":"Crossref","is-referenced-by-count":21,"title":["<i>In silico<\/i> based unraveling of New Delhi metallo-\u03b2-lactamase (NDM-1) inhibitors from natural compounds: a molecular docking and molecular dynamics simulation study"],"prefix":"10.1080","volume":"38","author":[{"given":"Mashihur","family":"Rahman","sequence":"first","affiliation":[{"name":"School of Life Sciences, B.S. Abdur Rahman Crescent Institute of Science and Technology, Chennai, India"}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Md. Khurshid Alam","family":"Khan","sequence":"additional","affiliation":[{"name":"School of Life Sciences, B.S. Abdur Rahman Crescent Institute of Science and Technology, Chennai, India"}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"301","published-online":{"date-parts":[[2019,6,11]]},"reference":[{"key":"CIT0001","doi-asserted-by":"publisher","DOI":"10.1021\/acs.biochem.7b00139"},{"key":"CIT0002","doi-asserted-by":"publisher","DOI":"10.1016\/j.bcp.2007.05.021"},{"key":"CIT0003","doi-asserted-by":"publisher","DOI":"10.1080\/01635581.2015.1087042"},{"key":"CIT0004","doi-asserted-by":"publisher","DOI":"10.1128\/AAC.01009-09"},{"key":"CIT0005","unstructured":"Case, D. A., Darden, T. A., Cheatham, T. E., III, Simmerling, C. L., Wang, J., Duke, R. E. \u2026 Kollman, P. A. (2012). Amber 12, University of California, San Francisco"},{"key":"CIT0006","doi-asserted-by":"publisher","DOI":"10.1111\/j.1527-3466.2007.00023.x"},{"key":"CIT0007","doi-asserted-by":"publisher","DOI":"10.1063\/1.470117"},{"key":"CIT0008","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0056926"},{"key":"CIT0009","doi-asserted-by":"publisher","DOI":"10.1038\/nprot.2016.051"},{"key":"CIT0010","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21366"},{"key":"CIT0011","doi-asserted-by":"publisher","DOI":"10.4155\/fmc-2016-0015"},{"key":"CIT0012","doi-asserted-by":"publisher","DOI":"10.1007\/s13238-011-1055-9"},{"key":"CIT0013","doi-asserted-by":"publisher","DOI":"10.1093\/jac\/dki130"},{"key":"CIT0014","doi-asserted-by":"publisher","DOI":"10.1063\/1.445869"},{"key":"CIT0015","doi-asserted-by":"publisher","DOI":"10.1186\/s12866-017-1012-8"},{"key":"CIT0016","doi-asserted-by":"publisher","DOI":"10.1371\/journal.pone.0024621"},{"key":"CIT0017","doi-asserted-by":"publisher","DOI":"10.1002\/pro.697"},{"key":"CIT0018","doi-asserted-by":"publisher","DOI":"10.1021\/jm01238a029"},{"key":"CIT0019","doi-asserted-by":"publisher","DOI":"10.1038\/nm1145"},{"key":"CIT0020","doi-asserted-by":"publisher","DOI":"10.1021\/acsinfecdis.8b00247"},{"key":"CIT0021","doi-asserted-by":"publisher","DOI":"10.1016\/S1056-8719(00)00107-6"},{"key":"CIT0022","doi-asserted-by":"publisher","DOI":"10.1016\/j.ddtec.2004.11.007"},{"key":"CIT0023","doi-asserted-by":"publisher","DOI":"10.1039\/c3np70114j"},{"key":"CIT0024","doi-asserted-by":"publisher","DOI":"10.1007\/s10456-004-1026-3"},{"key":"CIT0025","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.21256"},{"key":"CIT0026","doi-asserted-by":"publisher","DOI":"10.1128\/AAC.05961-11"},{"key":"CIT0027","doi-asserted-by":"publisher","DOI":"10.1080\/01635580802357352"},{"key":"CIT0028","doi-asserted-by":"publisher","DOI":"10.1016\/0021-9991(77)90098-5"},{"key":"CIT0029","doi-asserted-by":"publisher","DOI":"10.1179\/joc.2011.23.5.263"},{"issue":"5","key":"CIT0030","first-page":"271","volume":"51","author":"Shohat B.","year":"1967","journal-title":"Cancer Chemotherapy Reports"},{"key":"CIT0031","doi-asserted-by":"publisher","DOI":"10.1016\/j.ejmech.2017.04.035"},{"key":"CIT0032","doi-asserted-by":"publisher","DOI":"10.1007\/978-1-61779-012-6_1"},{"key":"CIT0033","volume-title":"Antimicrobial resistance: global report on surveillance","author":"WHO.","year":"2014"},{"key":"CIT0034","volume-title":"Global action plan on antimicrobial resistance","author":"WHO.","year":"2015"},{"key":"CIT0035","doi-asserted-by":"publisher","DOI":"10.1002\/jcc.20035"},{"key":"CIT0036","doi-asserted-by":"publisher","DOI":"10.1155\/2014\/569325"},{"key":"CIT0037","doi-asserted-by":"publisher","DOI":"10.1128\/AAC.00774-09"},{"key":"CIT0038","doi-asserted-by":"publisher","DOI":"10.1096\/fj.11-184036"}],"container-title":["Journal of Biomolecular Structure and Dynamics"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/www.tandfonline.com\/doi\/pdf\/10.1080\/07391102.2019.1627248","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2020,9,5]],"date-time":"2020-09-05T16:06:32Z","timestamp":1599321992000},"score":1,"resource":{"primary":{"URL":"https:\/\/www.tandfonline.com\/doi\/full\/10.1080\/07391102.2019.1627248"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2019,6,11]]},"references-count":38,"journal-issue":{"issue":"7","published-print":{"date-parts":[[2020,5,2]]}},"alternative-id":["10.1080\/07391102.2019.1627248"],"URL":"https:\/\/doi.org\/10.1080\/07391102.2019.1627248","relation":{},"ISSN":["0739-1102","1538-0254"],"issn-type":[{"value":"0739-1102","type":"print"},{"value":"1538-0254","type":"electronic"}],"subject":[],"published":{"date-parts":[[2019,6,11]]},"assertion":[{"value":"The publishing and review policy for this title is described in its Aims & Scope.","order":1,"name":"peerreview_statement","label":"Peer Review Statement"},{"value":"http:\/\/www.tandfonline.com\/action\/journalInformation?show=aimsScope&journalCode=tbsd20","URL":"http:\/\/www.tandfonline.com\/action\/journalInformation?show=aimsScope&journalCode=tbsd20","order":2,"name":"aims_and_scope_url","label":"Aim & Scope"},{"value":"2019-02-23","order":0,"name":"received","label":"Received","group":{"name":"publication_history","label":"Publication History"}},{"value":"2019-05-22","order":2,"name":"accepted","label":"Accepted","group":{"name":"publication_history","label":"Publication History"}},{"value":"2019-06-11","order":3,"name":"published","label":"Published","group":{"name":"publication_history","label":"Publication History"}}]}}